2O6T

crystal structure of the pa5185 protein from pseudomonas aeruginosa strain pao1- orthorhombic form (p2221).

• Total interactions analyzed: 15
• Total true interactions: 12
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 116
  • Norm. En. per Res.: -3.0823
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-C	-61.5337	16.7994	-312.818	-357.5523	116	11	15	11192	0	15	17
A-E	0.0	-8.5982	-29.8194	-38.4176	44	0	0	1821	0	8	8
A-G	0.0	-10.9987	-21.6376	-32.6363	24	1	0	1207	0	11	6
C-E	-4.2677	-13.4367	-32.5098	-50.2143	30	0	0	1333	0	12	11
C-G	0.0	-14.2163	-23.9652	-38.1815	34	0	0	1457	1	8	6
C-K	-9.4649	8.2426	-95.9926	-97.2149	54	3	0	3868	0	10	7
E-G	-45.7584	7.5705	-228.375	-266.5629	99	17	0	9637	8	16	11
E-I	0.0	-10.4106	-16.756	-27.1666	24	0	0	1046	0	10	6
E-K	0.0	-14.8825	-21.9232	-36.8057	33	0	0	1444	0	8	5
G-I	0.0	-11.2991	-26.304	-37.6031	42	0	0	1687	1	5	7
G-K	-6.9708	-27.2855	-22.1956	-56.4519	31	2	0	1160	0	11	11
I-K	-68.9803	17.0502	-301.343	-353.2731	119	18	15	10947	0	15	16

Interface residues

• A-C: ALA112A, ALA113A, ALA113C, ALA2A, ALA38A, ALA38C, ALA4A, ALA74A, ALA74C, ARG115A, ARG115C, ARG123A, ARG123C, ARG127C, ARG21A, ARG21C, ASN32A, ASN32C, ASN33A, ASN33C, ASN45A, ASN45C, ASP26A, ASP26C, ASP41A, ASP41C, ASP55A, ASP55C, ASP71A, ASP71C, CYS70A, CYS70C, GLN57A, GLN57C, GLY114A, GLY114C, GLY29A, GLY29C, GLY58A, GLY58C, GLY59A, GLY59C, GLY63A, GLY63C, HIS0A, HIS118A, HIS118C, HIS23A, HIS23C, HIS30A, HIS30C, ILE27A, ILE27C, ILE49A, ILE49C, ILE56A, ILE56C, ILE62A, ILE62C, LEU48A, LEU48C, LEU54A, LEU54C, LEU64A, LEU64C, MET1A, PHE116A, PHE116C, PHE120A, PHE120C, PHE39A, PHE39C, PHE40A, PHE40C, PHE73A, PHE73C, PRO128C, PRO75A, PRO75C, SER125C, SER126A, SER126C, SER67A, SER67C, SER68A, SER68C, SER69A, SER69C, THR35A, THR35C, THR3A, THR42A, THR42C, TYR28A, TYR28C, TYR36A, TYR36C, TYR37A, TYR37C, TYR72A, TYR72C, VAL117A, VAL117C, VAL119C, VAL121A, VAL121C, VAL31A, VAL31C, VAL34A, VAL34C, VAL61A, VAL61C, VAL65A, VAL65C, VAL66A, VAL66C
• A-E: ALA2A, ALA4A, ALA74E, ALA77E, ALA89A, ARG108E, ARG115A, ARG6A, ARG6E, ARG81E, ARG87A, ARG90A, ASN25E, ASN93A, ASP71A, CYS70A, GLN107E, GLN11A, GLN80E, GLN97A, GLU109E, GLU99A, GLY29E, GLY92A, HIS30E, LEU104E, LEU8E, PHE73A, PHE73E, PHE78E, PRO5A, PRO5E, PRO75E, PRO79E, PRO7A, SER67A, SER68A, SER69A, SER95A, THR3A, VAL117A, VAL31E, VAL66A, VAL76E
• A-G: ALA2A, ALA4A, ARG51G, ARG6A, ASP55G, GLN57G, GLU109A, GLU134G, GLU50G, GLY52G, GLY53G, GLY58G, GLY59G, HIS0A, ILE49G, ILE56G, LEU48G, LEU54G, LEU8A, MET1A, PRO5A, PRO7A, THR3A, THR46G
• C-E: ALA4C, ALA89C, ARG108E, ARG115C, ARG81E, ARG90C, ARG9E, ASN93C, ASP71C, CYS70C, GLN107E, GLN11E, GLN97C, GLU105E, GLU10E, GLU83E, GLU99C, GLY106E, GLY114C, GLY92C, LEU104E, LEU8E, PHE116C, PRO17E, PRO5C, SER67C, SER68C, SER69C, SER95C, VAL117C
• C-G: ALA130C, ALA138G, ALA140G, ALA141G, ARG127C, ARG136C, ARG136G, ARG51G, ASN93C, ASP137G, GLN133G, GLN16G, GLU122C, GLU134G, GLU50G, GLY52G, GLY53G, GLY92C, HIS14G, ILE131C, ILE49G, LEU13G, PHE120C, PHE15G, PRO128C, PRO17G, SER125C, SER126C, SER94C, SER95C, TYR47G, VAL119C, VAL121C, VAL129C
• C-K: ALA130C, ALA130K, ALA138C, ALA138K, ALA140C, ALA140K, ALA141C, ALA141K, ALA146C, ALA146K, ALA89C, ALA89K, ARG136C, ARG136K, ARG87C, ARG87K, ARG90C, ARG90K, ASN93C, ASN93K, ASP137C, ASP137K, GLN11C, GLN11K, GLN133C, GLN133K, GLN143C, GLN143K, GLN147K, GLU10C, GLU10K, GLU134C, GLY92C, GLY92K, ILE131C, ILE131K, LEU135C, LEU135K, LEU139C, LEU139K, LEU13C, LEU13K, LEU142C, LEU142K, LEU91C, LEU91K, PRO132C, PRO132K, SER144C, SER144K, SER145C, SER145K, VAL88C, VAL88K
• E-G: ALA38E, ALA38G, ALA43E, ALA43G, ALA77E, ALA77G, ARG123E, ARG123G, ARG21E, ARG21G, ARG81E, ARG81G, ASN25E, ASN25G, ASN45E, ASN45G, ASP24E, ASP24G, ASP26E, ASP26G, ASP41E, ASP41G, ASP55E, ASP55G, GLN16E, GLN16G, GLN57E, GLN57G, GLN80E, GLN80G, GLU50E, GLU50G, GLY29E, GLY29G, GLY63E, GLY63G, HIS118E, HIS118G, HIS23E, HIS23G, HIS30E, HIS30G, ILE18E, ILE18G, ILE27E, ILE27G, ILE49E, ILE49G, ILE56E, ILE56G, ILE62E, ILE62G, ILE82E, ILE82G, LEU102G, LEU48E, LEU48G, LEU54E, LEU54G, LEU64E, LEU64G, PHE39E, PHE39G, PHE40E, PHE40G, PHE78E, PHE78G, PRO17E, PRO17G, PRO79E, PRO79G, SER19E, SER19G, THR20E, THR20G, THR35E, THR35G, THR42E, THR42G, THR46E, THR46G, TRP22E, TRP22G, TYR28E, TYR28G, TYR36E, TYR36G, TYR37E, TYR37G, TYR47E, TYR47G, VAL31E, VAL31G, VAL44E, VAL44G, VAL65E, VAL65G, VAL76E, VAL76G
• E-I: ALA2I, ALA4I, ARG51E, ARG6I, ASP55E, GLN57E, GLU109I, GLU134E, GLU50E, GLY52E, GLY53E, GLY58E, GLY59E, HIS0I, ILE49E, ILE56E, LEU48E, LEU54E, LEU8I, MET1I, PRO5I, PRO7I, THR3I, THR46E
• E-K: ALA130K, ALA138E, ALA140E, ALA141E, ARG127K, ARG136E, ARG51E, ASN93K, ASP137E, GLN133E, GLN16E, GLU122K, GLU134E, GLU50E, GLY52E, GLY53E, HIS14E, ILE131K, ILE49E, LEU139E, LEU13E, PHE120K, PHE15E, PRO128K, PRO17E, SER125K, SER126K, SER94K, SER95K, TYR47E, VAL119K, VAL121K, VAL129K
• G-I: ALA2I, ALA4G, ALA4I, ALA74G, ALA77G, ALA89I, ARG108G, ARG115I, ARG6G, ARG81G, ARG87I, ARG90I, ASN25G, ASP71I, CYS70I, GLN107G, GLN11I, GLN80G, GLN97I, GLU109G, GLU99I, GLY29G, GLY92I, HIS30G, LEU104G, LEU8G, LEU91I, PHE73G, PHE73I, PHE78G, PRO5G, PRO5I, PRO75G, PRO79G, SER67I, SER68I, SER69I, THR3I, VAL117I, VAL31G, VAL66I, VAL76G
• G-K: ALA89K, ARG108G, ARG115K, ARG81G, ARG90K, ARG9G, ASN93K, ASP71K, GLN107G, GLN147K, GLN97K, GLU105G, GLU109G, GLU10G, GLU83G, GLU99K, GLY106G, GLY114K, GLY92K, LEU104G, LEU8G, PHE15G, PHE73K, PRO17G, PRO5K, SER67K, SER68K, SER69K, SER95K, TYR72K, VAL117K
• I-K: ALA112I, ALA112K, ALA113I, ALA113K, ALA2I, ALA38I, ALA38K, ALA4I, ALA74I, ALA74K, ARG115I, ARG115K, ARG123I, ARG123K, ARG124I, ARG124K, ARG127K, ARG21I, ARG21K, ASN32I, ASN32K, ASN33I, ASN33K, ASN45I, ASN45K, ASP26I, ASP26K, ASP41I, ASP41K, ASP55I, ASP55K, ASP71I, ASP71K, CYS70I, CYS70K, GLN57I, GLN57K, GLY114I, GLY114K, GLY29I, GLY29K, GLY58I, GLY58K, GLY59I, GLY59K, GLY63I, GLY63K, HIS0I, HIS118I, HIS118K, HIS23I, HIS23K, HIS30I, HIS30K, ILE27I, ILE27K, ILE49I, ILE49K, ILE56I, ILE56K, ILE62I, ILE62K, LEU135I, LEU48I, LEU48K, LEU54I, LEU54K, LEU64I, LEU64K, MET1I, PHE116I, PHE116K, PHE120I, PHE120K, PHE39I, PHE39K, PHE40I, PHE40K, PHE73I, PHE73K, PRO128K, PRO75I, PRO75K, SER125K, SER126I, SER126K, SER67I, SER67K, SER68I, SER68K, SER69I, SER69K, THR35I, THR35K, THR3I, THR42I, THR42K, TYR28I, TYR28K, TYR36I, TYR36K, TYR37I, TYR37K, TYR72I, TYR72K, VAL117I, VAL117K, VAL119K, VAL121K, VAL31I, VAL31K, VAL34I, VAL34K, VAL61I, VAL61K, VAL65I, VAL65K, VAL66I, VAL66K